Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 1/20 | 0.33 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.33 |
| ▸ | NMT1 | P30419 | 8/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16503027 | 0.85 | CNR2 (0.41) | HTTLMNASMN1; SMN2NPC1GALR3 | |
| SCHEMBL16509603 | 0.84 | HTT (0.57) | HTTLMNASMN1; SMN2NMT1CYP1A2 | |
| SCHEMBL16503019 | 0.76 | NMT1 (0.41) | HTTLMNASMN1; SMN2NPC1GALR3 | |
| SCHEMBL18904188 | 0.75 | KMT2A (0.46) | HTTLMNASMN1; SMN2NMT1 | |
| SCHEMBL28246340 | 0.74 | CYP2A6 (0.46) | HTTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18903979 | 0.71 | SMN1; SMN2 (0.37) | HTTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL28394794 | 0.71 | ALOX5 (0.42) | HTTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL18903977 | 0.71 | NMT1 (0.46) | HTTLMNASMN1; SMN2NMT1 | |
| SCHEMBL18903943 | 0.70 | HRH3 (0.43) | HTTLMNASMN1; SMN2NMT1 | |
| SCHEMBL18904219 | 0.70 | NMT1 (0.55) | NMT1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2980076-B1 | Pyrazolyl derivatives | UNIV DUNDEE (GB) | 2017-05-31 | — | — | EP | disclosed |